SCHEMBL2033342

SCHEMBL2033342

CC(C(=O)CN1CCCC(Nc2ccnc(-c3cnc4ccc(F)cn34)n2)C1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 13/20 0.42
JAK2 O60674 4/20 0.40
JAK3 P52333 4/20 0.40
JAK1 P23458 3/20 0.40
FLT3 P36888 1/20 0.37
IRAK4 Q9NWZ3 2/20 0.37
MAPK10 P53779 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1994465 0.85 EIF2AK4 (0.46) EIF2AK4JAK2JAK3JAK1IRAK4
SCHEMBL12610845 0.85 EIF2AK4 (0.46) EIF2AK4JAK2JAK3JAK1IRAK4
SCHEMBL2035797 0.84 EIF2AK4 (0.42) EIF2AK4JAK2JAK3JAK1FLT3
SCHEMBL2033344 0.84 EIF2AK4 (0.42) EIF2AK4JAK2JAK3JAK1FLT3
SCHEMBL2034169 0.84 EIF2AK4 (0.42) EIF2AK4JAK2JAK3JAK1FLT3
SCHEMBL1992517 0.81 EIF2AK4 (0.51) EIF2AK4IRAK4
SCHEMBL1992515 0.81 EIF2AK4 (0.51) EIF2AK4IRAK4
SCHEMBL12615713 0.81 EIF2AK4 (0.43) EIF2AK4
SCHEMBL12643666 0.81 EIF2AK4 (0.43) EIF2AK4
SCHEMBL2036807 0.80 EIF2AK4 (0.47) EIF2AK4JAK2JAK3JAK1FLT3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516436-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS Almirall S.A. (ES) 2012-10-31 EP disclosed
WO-2011076419-A1 IMIDAZOPYRIDINE DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2011-06-30 WO disclosed